ethyl 3-[[2-(3-acetamido-2-chloranyl-phenyl)carbonylpyrazolidin-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[2-(3-acetamido-2-chloranyl-phenyl)carbonylpyrazolidin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[2-(3-acetamido-2-chloro-benzoyl)pyrazolidine-1-carbonyl]amino]benzoate CAS Name: 3-[[[2-[(3-acetamido-2-chlorophenyl)-oxomethyl]-1-pyrazolidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(3-acetamido-2-chlorobenzoyl)pyrazolidine-1-carbonyl]amino]benzoate Traditional Name: 3-[[2-(3-acetamido-2-chloro-benzoyl)pyrazolidine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C22H23ClN4O5 MolecularWeight: 458.89482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCCN2C(=O)C3=C(C(=CC=C3)NC(=O)C)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)N2CCCN2C(=O)C3=C(C(=CC=C3)NC(=O)C)Cl

InChI

InChI=1S/C22H23ClN4O5/c1-3-32-21(30)15-7-4-8-16(13-15)25-22(31)27-12-6-11-26(27)20(29)17-9-5-10-18(19(17)23)24-14(2)28/h4-5,7-10,13H,3,6,11-12H2,1-2H3,(H,24,28)(H,25,31)